Crystallography Open Database

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Searching journal of publication like 'Acta Crystallographica Section B' volume of publication is 67

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2104930 CIF
Paper
C10 H34 N2 Ni O18P 1 21 18.145; 16.688; 8.932
90; 106.06; 90
1166.7Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt
Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory
Acta Crystallographica Section B, 2011, 67, 130-143
2104931 CIF
Paper
C10 H34 N2 Ni O18P 1 21 18.15; 16.693; 8.935
90; 106.05; 90
1168.2Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt
Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory
Acta Crystallographica Section B, 2011, 67, 130-143
2104932 CIF
Paper
C10 H34 N2 Ni O18P 1 21 18.158; 16.699; 8.941
90; 106.03; 90
1170.7Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt
Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory
Acta Crystallographica Section B, 2011, 67, 130-143
2104933 CIF
Paper
C10 H34 N2 Ni O18P 1 21 18.167; 16.703; 8.948
90; 106.02; 90
1173.2Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt
Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory
Acta Crystallographica Section B, 2011, 67, 130-143
2104934 CIF
Paper
C10 H34 N2 Ni O18P 1 21 18.18; 16.701; 8.96
90; 105.96; 90
1176.9Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt
Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory
Acta Crystallographica Section B, 2011, 67, 130-143
2104935 CIF
Paper
C10 H34 N2 Ni O18P 1 21 18.1578; 16.6971; 8.9482
90; 106.05; 90
1171.34Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt
Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory
Acta Crystallographica Section B, 2011, 67, 130-143
2104936 CIF
Paper
C10 H34 N2 Ni O18B 1 21 116.2526; 16.6254; 17.8851
90; 106.233; 90
4640Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt
Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory
Acta Crystallographica Section B, 2011, 67, 130-143
2104937 CIF
Paper
C10 H34 N2 Ni O18B 1 21 116.2401; 16.6007; 17.8912
90; 106.295; 90
4629.66Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt
Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory
Acta Crystallographica Section B, 2011, 67, 130-143
2104938 CIF
Paper
C10 H34 N2 Ni O18B 1 21 116.2238; 16.5763; 17.8917
90; 106.344; 90
4617.18Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt
Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory
Acta Crystallographica Section B, 2011, 67, 130-143
2104939 CIF
Paper
C10 H34 N2 Ni O18B 1 21 116.1879; 16.5322; 17.8839
90; 106.413; 90
4591.08Siegler, Maxime A.; Parkin, Sean; Angel, Ross J.; Brock, Carolyn Pratt
Detailed study of the phase transition in [Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·H~2~O and analysis in terms of mean-field theory
Acta Crystallographica Section B, 2011, 67, 130-143
2104940 CIF
HKL
Paper
C12 H40 Cd3 Cl10 N4C m c a7.4634; 22.0476; 19.6139
90; 90; 90
3227.5Gagor, Anna; Waśkowska, Alicja; Czapla, Zbigniew; Dacko, Slawomir
Structural phase transitions in tetra(isopropylammonium) decachlorotricadmate(II), [(CH~3~)~2~CHNH~3~]~4~Cd~3~Cl~10~, crystal with a two-dimensional cadmium(II) halide network
Acta Crystallographica Section B, 2011, 67, 122-129
2104941 CIF
HKL
Paper
C12 H40 Cd3 Cl10 N4P b c a7.4298; 22.0791; 19.4442
90; 90; 90
3189.7Gagor, Anna; Waśkowska, Alicja; Czapla, Zbigniew; Dacko, Slawomir
Structural phase transitions in tetra(isopropylammonium) decachlorotricadmate(II), [(CH~3~)~2~CHNH~3~]~4~Cd~3~Cl~10~, crystal with a two-dimensional cadmium(II) halide network
Acta Crystallographica Section B, 2011, 67, 122-129
2104942 CIF
HKL
Paper
C12 H40 Cd3 Cl10 N4P 21 21 217.3918; 22.0135; 19.3938
90; 90; 90
3155.75Gagor, Anna; Waśkowska, Alicja; Czapla, Zbigniew; Dacko, Slawomir
Structural phase transitions in tetra(isopropylammonium) decachlorotricadmate(II), [(CH~3~)~2~CHNH~3~]~4~Cd~3~Cl~10~, crystal with a two-dimensional cadmium(II) halide network
Acta Crystallographica Section B, 2011, 67, 122-129
2104943 CIF
HKL
Paper
C6 H14 OC 1 2/m 114.717; 7.76462; 6.22813
90; 101.015; 90
698.59Hammer, Sonja M.; Alig, Edith; Fink, Lothar; Schmidt, Martin U.
Predicted and experimental crystal structures of ethyl-<i>tert</i>-butyl ether
Acta Crystallographica Section B, 2011, 67, 155-162
2104944 CIF
HKL
Paper
C20 H36 N4 O4P 1 21/n 16.0341; 30.9087; 11.7024
90; 103.366; 90
2123.45Lemmerer, Andreas
Seven hexamethylenetetramine (HMTA) complexes with mono- and dicarboxylic acids: analysis of packing modes of HMTA complexes in the literature
Acta Crystallographica Section B, 2011, 67, 177-192
2104945 CIF
HKL
Paper
C20 H22 F2 N4 O4P 1 21/n 16.1529; 26.9424; 11.8758
90; 100.553; 90
1935.4Lemmerer, Andreas
Seven hexamethylenetetramine (HMTA) complexes with mono- and dicarboxylic acids: analysis of packing modes of HMTA complexes in the literature
Acta Crystallographica Section B, 2011, 67, 177-192
2104946 CIF
HKL
Paper
C22 H28 N4 O4P 1 21/n 16.1754; 28.234; 12.154
90; 99.869; 90
2087.8Lemmerer, Andreas
Seven hexamethylenetetramine (HMTA) complexes with mono- and dicarboxylic acids: analysis of packing modes of HMTA complexes in the literature
Acta Crystallographica Section B, 2011, 67, 177-192
2104947 CIF
HKL
Paper
C24 H28 N4 O4C m c 2130.803; 9.6904; 7.3655
90; 90; 90
2198.55Lemmerer, Andreas
Seven hexamethylenetetramine (HMTA) complexes with mono- and dicarboxylic acids: analysis of packing modes of HMTA complexes in the literature
Acta Crystallographica Section B, 2011, 67, 177-192
2104948 CIF
HKL
Paper
C20 H26 N6 O10C 1 2/c 112.0807; 7.473; 25.0633
90; 98.909; 90
2235.39Lemmerer, Andreas
Seven hexamethylenetetramine (HMTA) complexes with mono- and dicarboxylic acids: analysis of packing modes of HMTA complexes in the literature
Acta Crystallographica Section B, 2011, 67, 177-192
2104949 CIF
HKL
Paper
C14 H24 N4 O4P 1 21/m 15.9169; 21.6383; 6.1135
90; 108.028; 90
744.29Lemmerer, Andreas
Seven hexamethylenetetramine (HMTA) complexes with mono- and dicarboxylic acids: analysis of packing modes of HMTA complexes in the literature
Acta Crystallographica Section B, 2011, 67, 177-192
2104950 CIF
HKL
Paper
C14 H24 N4 O4F d d 223.7999; 44.9245; 5.7804
90; 90; 90
6180.4Lemmerer, Andreas
Seven hexamethylenetetramine (HMTA) complexes with mono- and dicarboxylic acids: analysis of packing modes of HMTA complexes in the literature
Acta Crystallographica Section B, 2011, 67, 177-192
2104951 CIF
Paper
Rb2 SP 63/m m c5.30756; 5.30756; 6.80615
90; 90; 120
166.044Santamaria-Perez, David; Vegas, Angel; Muehle, Claus; Jansen, Martin
High-pressure experimental study on Rb~2~S: antifluorite to Ni~2~In-type phase transitions
Acta Crystallographica Section B, 2011, 67, 109-115
2104952 CIF
Paper
Rb2 SP n m a8.167; 5.101; 9.957
90; 90; 90
414.8Santamaria-Perez, David; Vegas, Angel; Muehle, Claus; Jansen, Martin
High-pressure experimental study on Rb~2~S: antifluorite to Ni~2~In-type phase transitions
Acta Crystallographica Section B, 2011, 67, 109-115
2104953 CIF
HKL
Paper
C28 H16 O2P 1 21/n 110.186; 8.4277; 11.6457
90; 109.591; 90
941.85Johnstone, Russell D. L.; Allan, David; Lennie, Alistair; Pidcock, Elna; Valiente, Rafael; Rodríguez, Fernando; Gonzalez, Jesús; Warren, John; Parsons, Simon
The effect of pressure on the crystal structure of bianthrone
Acta Crystallographica Section B, 2011, 67, 226-237
2104954 CIF
HKL
Paper
C28 H16 O2P 1 21/n 19.9825; 7.8892; 11.4879
90; 109.78; 90
851.3Johnstone, Russell D. L.; Allan, David; Lennie, Alistair; Pidcock, Elna; Valiente, Rafael; Rodríguez, Fernando; Gonzalez, Jesús; Warren, John; Parsons, Simon
The effect of pressure on the crystal structure of bianthrone
Acta Crystallographica Section B, 2011, 67, 226-237
2104955 CIF
HKL
Paper
C28 H16 O2P 1 21/n 19.9021; 7.6543; 11.4225
90; 109.86; 90
814.3Johnstone, Russell D. L.; Allan, David; Lennie, Alistair; Pidcock, Elna; Valiente, Rafael; Rodríguez, Fernando; Gonzalez, Jesús; Warren, John; Parsons, Simon
The effect of pressure on the crystal structure of bianthrone
Acta Crystallographica Section B, 2011, 67, 226-237
2104956 CIF
HKL
Paper
C28 H16 O2P 1 21/n 19.8354; 7.4567; 11.3543
90; 109.939; 90
782.8Johnstone, Russell D. L.; Allan, David; Lennie, Alistair; Pidcock, Elna; Valiente, Rafael; Rodríguez, Fernando; Gonzalez, Jesús; Warren, John; Parsons, Simon
The effect of pressure on the crystal structure of bianthrone
Acta Crystallographica Section B, 2011, 67, 226-237
2104957 CIF
HKL
Paper
C28 H16 O2P 1 21/n 19.7854; 7.2988; 11.3074
90; 110.028; 90
758.75Johnstone, Russell D. L.; Allan, David; Lennie, Alistair; Pidcock, Elna; Valiente, Rafael; Rodríguez, Fernando; Gonzalez, Jesús; Warren, John; Parsons, Simon
The effect of pressure on the crystal structure of bianthrone
Acta Crystallographica Section B, 2011, 67, 226-237
2104958 CIF
HKL
Paper
C28 H16 O2P 1 21/n 19.7527; 7.2058; 11.2786
90; 110.132; 90
744.19Johnstone, Russell D. L.; Allan, David; Lennie, Alistair; Pidcock, Elna; Valiente, Rafael; Rodríguez, Fernando; Gonzalez, Jesús; Warren, John; Parsons, Simon
The effect of pressure on the crystal structure of bianthrone
Acta Crystallographica Section B, 2011, 67, 226-237
2104959 CIF
HKL
Paper
C28 H16 O2P 1 21/n 19.7286; 7.1123; 11.2468
90; 110.186; 90
730.4Johnstone, Russell D. L.; Allan, David; Lennie, Alistair; Pidcock, Elna; Valiente, Rafael; Rodríguez, Fernando; Gonzalez, Jesús; Warren, John; Parsons, Simon
The effect of pressure on the crystal structure of bianthrone
Acta Crystallographica Section B, 2011, 67, 226-237
2104960 CIF
HKL
Paper
C28 H16 O2P 1 21/n 19.7119; 7.041; 11.2282
90; 110.229; 90
720.4Johnstone, Russell D. L.; Allan, David; Lennie, Alistair; Pidcock, Elna; Valiente, Rafael; Rodríguez, Fernando; Gonzalez, Jesús; Warren, John; Parsons, Simon
The effect of pressure on the crystal structure of bianthrone
Acta Crystallographica Section B, 2011, 67, 226-237
2104961 CIF
HKL
Paper
C18 H8 Br4 O2 S8P 1 21/n 110.3653; 11.7998; 11.0749
90; 110.217; 90
1271.1García-Orduña, Pilar; Dahaoui, Slimane; Lecomte, Claude
Intermolecular interactions and charge transfer in the 2:1 tetrathiafulvalene bromanil complex, (TTF)~2~-BA
Acta Crystallographica Section B, 2011, 67, 244-249
2104962 CIF
HKL
Paper
C18 H8 Br4 O2 S8P 1 21/n 110.2781; 11.5982; 11.0418
90; 110.434; 90
1233.44García-Orduña, Pilar; Dahaoui, Slimane; Lecomte, Claude
Intermolecular interactions and charge transfer in the 2:1 tetrathiafulvalene bromanil complex, (TTF)~2~-BA
Acta Crystallographica Section B, 2011, 67, 244-249
2104963 CIF
HKL
Paper
C18 H8 Br4 O2 S8P 1 21/n 110.2507; 11.5276; 10.9799
90; 110.446; 90
1215.71García-Orduña, Pilar; Dahaoui, Slimane; Lecomte, Claude
Intermolecular interactions and charge transfer in the 2:1 tetrathiafulvalene bromanil complex, (TTF)~2~-BA
Acta Crystallographica Section B, 2011, 67, 244-249
2104964 CIF
Paper
Na O3 Ti1.25C 1 2/m 121.555; 3.7583; 11.926
90; 136.14; 90
669.4Andrusenko, Iryna; Mugnaioli, Enrico; Gorelik, Tatiana E.; Koll, Dominik; Panthöfer, Martin; Tremel, Wolfgang; Kolb, Ute
Structure analysis of titanate nanorods by automated electron diffraction tomography
Acta Crystallographica Section B, 2011, 67, 218-225
2104965 CIF
HKL
Paper
Al14 Ca12 O33I -4 3 d11.989; 11.989; 11.989
90; 90; 90
1723.3Sakakura, Terutoshi; Tanaka, Kiyoaki; Takenaka, Yasuyuki; Matsuishi, Satoru; Hosono, Hideo; Kishimoto, Shunji
Determination of the local structure of a cage with an oxygen ion in Ca~12~Al~14~O~33~
Acta Crystallographica Section B, 2011, 67, 193-204
2104966 CIF
HKL
Paper
C8 H8 N2 O2P -15.7913; 8.2458; 8.9223
116.823; 104.589; 91.602
362.99Zarychta, Bartosz; Zaleski, Jacek; Kyzioł, Janusz; Daszkiewicz, Zdzisław; Jelsch, Christian
Charge-density analysis of 1-nitroindoline: refinement quality using free <i>R</i> factors and restraints
Acta Crystallographica Section B, 2011, 67, 250-262
2104967 CIF
HKL
Paper
C15 H24 N3 O3 PP 1 21/n 19.517; 10.723; 32.993
90; 96.029; 90
3348.3Gholivand, Khodayar; Mahzouni, Hamid Reza
Solid-state and gas-phase structures of two conformers of <i>N</i>-(4-methylphenyl)-<i>N</i>',<i>N</i>''-bis(morpholinyl) phosphoric triamide; insights from X-ray crystallography and DFT calculations
Acta Crystallographica Section B, 2011, 67, 238-243
2104968 CIF
Paper
C84 H106 B2 Co2 N4 O10C 1 2/c 122.8118; 19.2667; 17.3077
90; 96.176; 90
7562.7Deutsch, Maxime; Claiser, Nicolas; Gillet, Jean-Michel; Lecomte, Claude; Sakiyama, Hiroshi; Tone, Katsuya; Souhassou, Mohamed
<i>d</i>-Orbital orientation in a dimer cobalt complex: link to magnetic properties?
Acta Crystallographica Section B, 2011, 67, 324-332
2104969 CIF
HKL
Paper
C20 H30 N2 O4 Sn2P b c a13.0745; 12.9669; 13.6824
90; 90; 90
2319.66Korlyukov, Alexander A.; Khrustalev, Victor N.; Vologzhanina, Anna V.; Lyssenko, Konstantin A.; Nechaev, Mikhail. S.; Antipin, Mikhail Yu.
Bis(μ^2^-2-(dimethylamino)ethoxo-<i>N</i>,<i>O</i>,<i>O</i>)-di(phenolato-<i>O</i>)ditin(II): a high-resolution single-crystal X-ray diffraction and quantum chemical study
Acta Crystallographica Section B, 2011, 67, 315-323
2104970 CIF
HKL
Paper
C10 H10 N4 O2P 1 21/c 111.0299; 10.0921; 18.6365
90; 97.238; 90
2057.99Paul, Agnieszka; Kubicki, Maciej; Jelsch, Christian; Durand, Pierrick; Lecomte, Claude
<i>R</i>-free factor and experimental charge-density analysis of 1-(2'-aminophenyl)-2-methyl-4-nitroimidazole: a crystal structure with <i>Z</i>' = 2
Acta Crystallographica Section B, 2011, 67, 365-378
2104971 CIF
HKL
Paper
C3 H5 Cl O SP 1 21/c 19.4763; 5.8288; 11.0764
90; 112.853; 90
563.79Rodríguez Pirani, Lucas; Erben, Mauricio F.; Boese, Roland; Pozzi, C. Gustavo; Fantoni, Adolfo C.; Della Védova, Carlos O.
Conformational preference of chlorothioformate species: molecular structure of ethyl chlorothioformate, ClC(O)SCH~2~CH~3~, in the solid phase and NBO analysis
Acta Crystallographica Section B, 2011, 67, 350-356
2104972 CIF
HKL
Paper
Ca H1.25 O4.625 SeP 32 2 114.1681; 14.1681; 13.4241
90; 90; 120
2333.67Fritz, Susanne; Schmidt, Horst; Paschke, Iris; Magdysyuk, Oxana V.; Dinnebier, Robert E.; Freyer, Daniela; Voigt, Wolfgang
CaSeO~4~·0.625H~2~O ‒ water channel occupation in a bassanite related structure
Acta Crystallographica Section B, 2011, 67, 293-301
2104973 CIF
Paper
Ca H1.25 O4.625 SeP 32 2 114.1035; 14.1035; 13.3622
90; 90; 120
2301.8Fritz, Susanne; Schmidt, Horst; Paschke, Iris; Magdysyuk, Oxana V.; Dinnebier, Robert E.; Freyer, Daniela; Voigt, Wolfgang
CaSeO~4~·0.625H~2~O ‒ water channel occupation in a bassanite related structure
Acta Crystallographica Section B, 2011, 67, 293-301
2104974 CIF
HKL
Paper
C7 H4 Cl2 OP 1 21/c 13.7888; 13.7784; 13.0368
90; 90.979; 90
680.47Solanko, Katarzyna A.; Bond, Andrew D.
Intermolecular interactions and unexpected isostructurality in the crystal structures of the dichlorobenzaldehyde isomers
Acta Crystallographica Section B, 2011, 67, 437-445
2104975 CIF
HKL
Paper
C7 H4 Cl2 OP -13.815; 7.829; 17.895
89.091; 85.728; 81.115
526.6Solanko, Katarzyna A.; Bond, Andrew D.
Intermolecular interactions and unexpected isostructurality in the crystal structures of the dichlorobenzaldehyde isomers
Acta Crystallographica Section B, 2011, 67, 437-445
2104976 CIF
HKL
Paper
C7 H4 Cl2 OP 1 21 13.8094; 14.8887; 6.2014
90; 91.849; 90
351.54Solanko, Katarzyna A.; Bond, Andrew D.
Intermolecular interactions and unexpected isostructurality in the crystal structures of the dichlorobenzaldehyde isomers
Acta Crystallographica Section B, 2011, 67, 437-445
2104977 CIF
HKL
Paper
C7 H4 Cl2 OP 1 21/n 13.7785; 31.353; 12.058
90; 91.546; 90
1428Solanko, Katarzyna A.; Bond, Andrew D.
Intermolecular interactions and unexpected isostructurality in the crystal structures of the dichlorobenzaldehyde isomers
Acta Crystallographica Section B, 2011, 67, 437-445
2104978 CIF
Paper
C6 H4 S2 Tl2P -16.5525; 6.8444; 9.5265
71.798; 85.988; 89.219
404.86Stone, Kevin H.; Turner, Dayna L.; Singh, Mayank Pratap; Vaid, Thomas P.; Stephens, Peter W.
Hidden superlattice in Tl~2~(SC~6~H~4~S) and Tl~2~(SeC~6~H~4~Se) solved from powder X-ray diffraction
Acta Crystallographica Section B, 2011, 67, 409-415
2104979 CIF
Paper
C6 H4 Se2 Tl2P -16.67438; 6.84998; 9.82649
72.513; 84.79; 88.659
426.725Stone, Kevin H.; Turner, Dayna L.; Singh, Mayank Pratap; Vaid, Thomas P.; Stephens, Peter W.
Hidden superlattice in Tl~2~(SC~6~H~4~S) and Tl~2~(SeC~6~H~4~Se) solved from powder X-ray diffraction
Acta Crystallographica Section B, 2011, 67, 409-415

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